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2-(Carboxymethyl)-4,6-dihydroxy-benzoic acid

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2-(Carboxymethyl)-4,6-dihydroxy-benzoic acid
SpectraBase Compound ID FhgvNRuikZ7
InChI InChI=1S/C9H8O6/c10-5-1-4(2-7(12)13)8(9(14)15)6(11)3-5/h1,3,10-11H,2H2,(H,12,13)(H,14,15)
InChIKey UQKJJNNRZRKKLA-UHFFFAOYSA-N
Mol Weight 212.16 g/mol
Molecular Formula C9H8O6
Exact Mass 212.032088 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6RRC5Hi2bcS
Name 2-(Carboxymethyl)-4,6-dihydroxy-benzoic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.032087972 u
Formula C9H8O6
InChI InChI=1S/C9H8O6/c10-5-1-4(2-7(12)13)8(9(14)15)6(11)3-5/h1,3,10-11H,2H2,(H,12,13)(H,14,15)
InChIKey UQKJJNNRZRKKLA-UHFFFAOYSA-N
Molecular Weight 212.157 g/mol
SMILES C1(=C(CC(=O)O)C=C(C=C1O)O)C(=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.988427